Acrylic Acid

Acrylic Acid

SCHEMBL3666285

C=CC(=O)O.C=CC(=O)OCC=CO

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.43
ALDH1A1 P00352 4/20 0.43
TP53 P04637 3/20 0.43
HIF1A Q16665 3/20 0.43
CYP3A4 P08684 2/20 0.43
HSD17B10 Q99714 2/20 0.43
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HPGD P15428 1/20 0.39
THRB P10828 2/20 0.37
ALOX15 P16050 1/20 0.33
MAPT P10636 1/20 0.32
CACNA1B Q00975 1/20 0.32
APBA1 Q02410 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10608809 0.94
SCHEMBL29156 0.94
Ethylene SCHEMBL8677971 0.91 TSHR (0.46) TSHRALDH1A1TP53HIF1ACYP3A4
Charcoal, Activated SCHEMBL11360977 0.91 TSHR (0.46) TSHRALDH1A1TP53HIF1ACYP3A4
Acrylic Acid Methyl Ester SCHEMBL27814265 0.91 TSHR (0.39) TSHRALDH1A1TP53HIF1ACYP3A4
Acetic Acid SCHEMBL28788004 0.90 TSHR (0.44) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL2641211 0.88 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
Vinyl Chloride SCHEMBL10416733 0.88 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
Acrylic Acid SCHEMBL11775493 0.87 TSHR (0.36) TSHRALDH1A1TP53HIF1ACYP3A4
Phosphoric Acid SCHEMBL16360251 0.86 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2148643-A1 HIGHLY CHARGED MICROCAPSULES Aquea Scientific Corporation (US) 2010-02-03 EP disclosed
US-20080317795-A1 HIGHLY CHARGED MICROCAPSULES AQUEA SCIENTIFIC CORPORATION 2008-12-25 US disclosed
WO-2008144734-A1 HIGHLY CHARGED MICROCAPSULES AQUEA SCIENTIFIC CORPORATION (US) 2008-11-27 WO disclosed